N-cycloheptyl-2-(4-fluorophenyl)acetamide

C15H20FNO — CID 807912

IUPACN-cycloheptyl-2-(4-fluorophenyl)acetamide
SMILESO=C(Cc1ccc(F)cc1)NC1CCCCCC1
InChIInChI=1S/C15H20FNO/c16-13-9-7-12(8-10-13)11-15(18)17-14-5-3-1-2-4-6-14/h7-10,14H,1-6,11H2,(H,17,18)
InChIKeyOMKXVLCYWAFEIE-UHFFFAOYSA-N
MW249.33 g/mol
LogP3.21
Rot. Bonds3

About N-cycloheptyl-2-(4-fluorophenyl)acetamide

N-cycloheptyl-2-(4-fluorophenyl)acetamide (PubChem CID 807912) has the molecular formula C15H20FNO and a molecular weight of 249.33 g/mol. Its IUPAC name is N-cycloheptyl-2-(4-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-cycloheptyl-2-(4-fluorophenyl)acetamide
PubChem CID807912
Molecular FormulaC15H20FNO
Molecular Weight249.33 g/mol
Exact Mass249.15
IUPAC NameN-cycloheptyl-2-(4-fluorophenyl)acetamide
SMILESO=C(Cc1ccc(F)cc1)NC1CCCCCC1
InChIInChI=1S/C15H20FNO/c16-13-9-7-12(8-10-13)11-15(18)17-14-5-3-1-2-4-6-14/h7-10,14H,1-6,11H2,(H,17,18)
InChIKeyOMKXVLCYWAFEIE-UHFFFAOYSA-N
XLogP3.21
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.33
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-2-(4-fluorophenyl)acetamide?
The IUPAC name of N-cycloheptyl-2-(4-fluorophenyl)acetamide (CID 807912) is N-cycloheptyl-2-(4-fluorophenyl)acetamide.
What is the SMILES notation for N-cycloheptyl-2-(4-fluorophenyl)acetamide?
The canonical SMILES for N-cycloheptyl-2-(4-fluorophenyl)acetamide is O=C(Cc1ccc(F)cc1)NC1CCCCCC1.
What is the InChIKey of N-cycloheptyl-2-(4-fluorophenyl)acetamide?
The InChIKey is OMKXVLCYWAFEIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO/c16-13-9-7-12(8-10-13)11-15(18)17-14-5-3-1-2-4-6-14/h7-10,14H,1-6,11H2,(H,17,18).
What are the key properties of N-cycloheptyl-2-(4-fluorophenyl)acetamide?
N-cycloheptyl-2-(4-fluorophenyl)acetamide has a molecular weight of 249.33 g/mol, XLogP of 3.21, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-2-(4-fluorophenyl)acetamide is sourced from PubChem (CID 807912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).